In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 34 | Yes |
Popular Name: 2-[4-(4-isobutylphenyl)sulfonylpiperazin-1-yl]-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide 2-[4-(4-isobutylphenyl)sulfonylp…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 4.25 | 8.07 | -24.01 | 1 | 8 | 0 | 96 | 499.662 | 8 | ↓ |
Hi High (pH 8-9.5) | 4.07 | 7.15 | -49.52 | 0 | 8 | -1 | 102 | 498.654 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.25 | 10.44 | -64.73 | 2 | 8 | 1 | 97 | 500.67 | 8 | ↓ |